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(E)-2-(4-CHLOROBENZENESULFENYL)-1-CHLORO-3-METHYL-1-BUTENE
SpectraBase Compound ID 4n68tefOO0d
InChI InChI=1S/C11H12Cl2S/c1-8(2)11(7-12)14-10-5-3-9(13)4-6-10/h3-8H,1-2H3/b11-7+
InChIKey SZHQTRBSOYIVAF-YRNVUSSQSA-N
Mol Weight 247.18 g/mol
Molecular Formula C11H12Cl2S
Exact Mass 246.003677 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3LRomE2ovAX
Name (E)-2-(4-CHLOROBENZENESULFENYL)-1-CHLORO-3-METHYL-1-BUTENE
CAS Registry Number 58866-58-3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12Cl2S
InChI InChI=1S/C11H12Cl2S/c1-8(2)11(7-12)14-10-5-3-9(13)4-6-10/h3-8H,1-2H3/b11-7+
InChIKey SZHQTRBSOYIVAF-YRNVUSSQSA-N
Literature Reference Author G.H.SCHMID,A.MODRO,F.LENZ,D.G.GARRATT,K.YATES
Literature Reference Citation J.ORG.CHEM.,41,13(1976)
Literature Reference DOI 10.1021/jo00863a003
Molecular Weight 247.182 g/mol
Solvent CDCl3
Source File Reference UWCS11432